N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)-2,4-dimethylbenzamide

C21H18N4O — CID 121033061

IUPACN-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)-2,4-dimethylbenzamide
SMILESCc1ccc(C(=O)Nc2ccc(-c3cn4cccnc4n3)cc2)c(C)c1
InChIInChI=1S/C21H18N4O/c1-14-4-9-18(15(2)12-14)20(26)23-17-7-5-16(6-8-17)19-13-25-11-3-10-22-21(25)24-19/h3-13H,1-2H3,(H,23,26)
InChIKeyYESJJUNBVVRFEK-UHFFFAOYSA-N
MW342.40 g/mol
LogP4.27
Rot. Bonds3

About N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)-2,4-dimethylbenzamide

N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)-2,4-dimethylbenzamide (PubChem CID 121033061) has the molecular formula C21H18N4O and a molecular weight of 342.40 g/mol. Its IUPAC name is N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)-2,4-dimethylbenzamide.

Molecular Properties

Compound NameN-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)-2,4-dimethylbenzamide
PubChem CID121033061
Molecular FormulaC21H18N4O
Molecular Weight342.40 g/mol
Exact Mass342.15
IUPAC NameN-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)-2,4-dimethylbenzamide
SMILESCc1ccc(C(=O)Nc2ccc(-c3cn4cccnc4n3)cc2)c(C)c1
InChIInChI=1S/C21H18N4O/c1-14-4-9-18(15(2)12-14)20(26)23-17-7-5-16(6-8-17)19-13-25-11-3-10-22-21(25)24-19/h3-13H,1-2H3,(H,23,26)
InChIKeyYESJJUNBVVRFEK-UHFFFAOYSA-N
XLogP4.27
TPSA59.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.40
LogP ≤ 54.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)-2,4-dimethylbenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2,4-dimethyl-N-[4-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide
CID 121089708
N-(5-imidazo[1,2-a]pyrimidin-2-yl-2-methylphenyl)-2,5-dimethylbenzamide
CID 121033035
4-ethyl-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)benzamide
CID 121033065
N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)-2,4-dimethylbenzenesulfonamide
CID 121028727
N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)-2,5-dimethylaniline
CID 121335716
N-(3-imidazo[1,2-a]pyrimidin-2-ylphenyl)-8-methylquinoline-5-carboxamide
CID 167780331
5-bromo-2-chloro-N-(5-imidazo[1,2-a]pyrimidin-2-yl-2-methylphenyl)benzamide
CID 27536916
N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)-2-propylpentanamide
CID 20868684
5-chloro-6-ethoxy-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)pyridine-3-carboxamide
CID 99807438
5-amino-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)-2,4-dioxo-1H-pyrimidine-6-carboxamide
CID 167937463
2-(4-imidazo[1,2-a]pyrimidin-2-ylanilino)ethene-1,1,2-tricarbonitrile
CID 168610794
(E)-N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)-3-pyridin-2-ylprop-2-enamide
CID 75417013

Frequently Asked Questions

What is the IUPAC name of N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)-2,4-dimethylbenzamide?
The IUPAC name of N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)-2,4-dimethylbenzamide (CID 121033061) is N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)-2,4-dimethylbenzamide.
What is the SMILES notation for N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)-2,4-dimethylbenzamide?
The canonical SMILES for N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)-2,4-dimethylbenzamide is Cc1ccc(C(=O)Nc2ccc(-c3cn4cccnc4n3)cc2)c(C)c1.
What is the InChIKey of N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)-2,4-dimethylbenzamide?
The InChIKey is YESJJUNBVVRFEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18N4O/c1-14-4-9-18(15(2)12-14)20(26)23-17-7-5-16(6-8-17)19-13-25-11-3-10-22-21(25)24-19/h3-13H,1-2H3,(H,23,26).
What are the key properties of N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)-2,4-dimethylbenzamide?
N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)-2,4-dimethylbenzamide has a molecular weight of 342.40 g/mol, XLogP of 4.27, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-imidazo[1,2-a]pyrimidin-2-ylphenyl)-2,4-dimethylbenzamide is sourced from PubChem (CID 121033061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).